ethyl 2-[(7-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(7-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-[(7-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
Compound ID: | 7656-0905 |
Compound Name: | ethyl 2-[(7-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
Molecular Weight: | 399.46 |
Molecular Formula: | C21 H21 N O5 S |
Smiles: | CCOC(c1c2CCCc2sc1NC(C1Cc2ccc(C)cc2C(=O)O1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.08 |
logD: | 1.3359 |
logSw: | -4.3813 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.988 |
InChI Key: | UVVOMQRXXHWVHW-HNNXBMFYSA-N |